N-(azepan-1-ylcarbothioyl)-2-bromanyl-benzamide

Systemtic Name: N-(azepan-1-ylcarbothioyl)-2-bromanyl-benzamide Openeye Name: N-(azepane-1-carbothioyl)-2-bromo-benzamide CAS Name: N-[1-azepanyl(sulfanylidene)methyl]-2-bromobenzamide IUPAC Name: N-(azepane-1-carbothioyl)-2-bromobenzamide Traditional Name: N-(azepane-1-carbothioyl)-2-bromo-benzamide Formula: C14H17BrN2OS MolecularWeight: 341.26658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

C1CCCN(CC1)C(=S)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C14H17BrN2OS/c15-12-8-4-3-7-11(12)13(18)16-14(19)17-9-5-1-2-6-10-17/h3-4,7-8H,1-2,5-6,9-10H2,(H,16,18,19)